Name: Name:1-Iodo-3,5-dinitrobenzene
Brand: Angene
SKU: AG003EFL
Rating: 90 (10 reviews)

1-Iodo-3,5-dinitrobenzene

CAS No.:

6276-04-6

Catalog Number:

AG003EFL

Molecular Formula:

C6H3IN2O4

Molecular Weight:

294.0035

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

250mg

98%

1 week

United States

$64

- +

98%

1 week

United States

$80

- +

Product Description

Catalog Number:

AG003EFL

Chemical Name:

1-Iodo-3,5-dinitrobenzene

CAS Number:

6276-04-6

Molecular Formula:

C6H3IN2O4

Molecular Weight:

294.0035

MDL Number:

MFCD00024330

IUPAC Name:

1-iodo-3,5-dinitrobenzene

InChI:

InChI=1S/C6H3IN2O4/c7-4-1-5(8(10)11)3-6(2-4)9(12)13/h1-3H

InChI Key:

AISNAASNOWRWIR-UHFFFAOYSA-N

SMILES:

Ic1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-]

NSC Number:

36447

Properties

Complexity:

202

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

293.914g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

294.004g/mol

Monoisotopic Mass:

293.914g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

91.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.2

Literature

Title	Journal
3,3',5,5'-Tetra-nitro-biphen-yl.	Acta crystallographica. Section E, Structure reports online 20090501
Secondary interactions in 1-iodo-3-nitrobenzene and 1-iodo-3,5-dinitrobenzene.	Acta crystallographica. Section C, Crystal structure communications 20030201

Properties